N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride

C16H22ClN7 — CID 163302339

IUPACN-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride
SMILESCNC1CCCN(c2nc(-c3cnn(C)c3)cc3nccn23)C1.Cl
InChIInChI=1S/C16H21N7.ClH/c1-17-13-4-3-6-22(11-13)16-20-14(12-9-19-21(2)10-12)8-15-18-5-7-23(15)16;/h5,7-10,13,17H,3-4,6,11H2,1-2H3;1H
InChIKeyOZVQASSNMFJLQJ-UHFFFAOYSA-N
MW347.85 g/mol
LogP1.74
Rot. Bonds3

About N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride

N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride (PubChem CID 163302339) has the molecular formula C16H22ClN7 and a molecular weight of 347.85 g/mol. Its IUPAC name is N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride
PubChem CID163302339
Molecular FormulaC16H22ClN7
Molecular Weight347.85 g/mol
Exact Mass347.16
IUPAC NameN-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride
SMILESCNC1CCCN(c2nc(-c3cnn(C)c3)cc3nccn23)C1.Cl
InChIInChI=1S/C16H21N7.ClH/c1-17-13-4-3-6-22(11-13)16-20-14(12-9-19-21(2)10-12)8-15-18-5-7-23(15)16;/h5,7-10,13,17H,3-4,6,11H2,1-2H3;1H
InChIKeyOZVQASSNMFJLQJ-UHFFFAOYSA-N
XLogP1.74
TPSA63.28 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.85
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 159912281
5-[(4S)-1-ethenylsulfonylazepan-4-yl]oxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidine
CID 163302220
N,3-dimethyl-3-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]oxycyclobutan-1-amine;2,2,2-trifluoroacetic acid
CID 175743593
1-[(4S)-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]oxyazepan-1-yl]prop-2-en-1-one
CID 163301608
(2R,4S)-4-cyclopropyl-4-[3-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]pyrrol-1-yl]butan-2-ol
CID 90336488
5-(1-but-3-ynylpyrazol-4-yl)-7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidine
CID 71523168
5-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]imidazo[1,2-c]pyrimidine-7-carboxylic acid
CID 167942127
4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]pyrimidine
CID 31125821
1-(4-ethyl-1-methylimidazol-2-yl)-N-methylpiperidin-3-amine
CID 106552545
2-[1-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]pyrazol-1-yl]cycloheptyl]acetonitrile
CID 123763551
N-methyl-1-(5-methyl-3-pyridinyl)piperidin-3-amine
CID 107586864
5-[1-[(1S)-1-[(1R)-2,2-difluorocyclopropyl]-3-fluoropropyl]pyrrol-3-yl]-7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidine
CID 71523363

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride?
The IUPAC name of N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride (CID 163302339) is N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride?
The canonical SMILES for N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride is CNC1CCCN(c2nc(-c3cnn(C)c3)cc3nccn23)C1.Cl.
What is the InChIKey of N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride?
The InChIKey is OZVQASSNMFJLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7.ClH/c1-17-13-4-3-6-22(11-13)16-20-14(12-9-19-21(2)10-12)8-15-18-5-7-23(15)16;/h5,7-10,13,17H,3-4,6,11H2,1-2H3;1H.
What are the key properties of N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride?
N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride has a molecular weight of 347.85 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]piperidin-3-amine;hydrochloride is sourced from PubChem (CID 163302339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).