N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine

C10H18N4 — CID 170247526

IUPACN,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine
SMILESCN(C)c1cnn([C@H]2CCCNC2)c1
InChIInChI=1S/C10H18N4/c1-13(2)10-7-12-14(8-10)9-4-3-5-11-6-9/h7-9,11H,3-6H2,1-2H3/t9-/m0/s1
InChIKeyYHECKQIJPDLZEZ-VIFPVBQESA-N
MW194.28 g/mol
LogP0.87
Rot. Bonds2

About N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine

N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine (PubChem CID 170247526) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine
PubChem CID170247526
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine
SMILESCN(C)c1cnn([C@H]2CCCNC2)c1
InChIInChI=1S/C10H18N4/c1-13(2)10-7-12-14(8-10)9-4-3-5-11-6-9/h7-9,11H,3-6H2,1-2H3/t9-/m0/s1
InChIKeyYHECKQIJPDLZEZ-VIFPVBQESA-N
XLogP0.87
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-3-(4-tert-butylpyrazol-1-yl)piperidine
CID 170927501
3-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]piperidine
CID 84734594
3-(4-bromopyrazol-1-yl)piperidine;tert-butyl formate
CID 174626038
4-chloro-1-pyrrolidin-3-ylpyrazole
CID 62329636
1-(1-piperidin-3-yltriazol-4-yl)ethanone
CID 164663675
4-[(2-methylpropan-2-yl)oxy]-1-pyrrolidin-3-ylpyrazole
CID 117124968
1-[(4S)-azepan-4-yl]pyrazol-4-amine
CID 171834882
4-(4-methylsulfonylpyrazol-1-yl)azepane
CID 165477573
1-cycloheptyl-4-pyrrolidin-3-ylpyrazole
CID 105493602
3-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]piperidine
CID 105495229
N-[2-(cyclopropylamino)-2-oxoethyl]-1-piperidin-3-ylpyrazole-4-carboxamide
CID 138001192
5-[2-methoxyethyl(methyl)amino]-2-piperidin-3-ylpyridazin-3-one
CID 119030875

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine?
The IUPAC name of N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine (CID 170247526) is N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine.
What is the SMILES notation for N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine?
The canonical SMILES for N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine is CN(C)c1cnn([C@H]2CCCNC2)c1.
What is the InChIKey of N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine?
The InChIKey is YHECKQIJPDLZEZ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H18N4/c1-13(2)10-7-12-14(8-10)9-4-3-5-11-6-9/h7-9,11H,3-6H2,1-2H3/t9-/m0/s1.
What are the key properties of N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine?
N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(3S)-piperidin-3-yl]pyrazol-4-amine is sourced from PubChem (CID 170247526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).