N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine

C18H29N3 — CID 81254130

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
SMILESCc1cc(N(CC2CC2)C2CC2)c(CNCC(C)C)cn1
InChIInChI=1S/C18H29N3/c1-13(2)9-19-10-16-11-20-14(3)8-18(16)21(17-6-7-17)12-15-4-5-15/h8,11,13,15,17,19H,4-7,9-10,12H2,1-3H3
InChIKeyWVIVUGAAWLHGNR-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.51
Rot. Bonds8

About N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine

N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine (PubChem CID 81254130) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
PubChem CID81254130
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
SMILESCc1cc(N(CC2CC2)C2CC2)c(CNCC(C)C)cn1
InChIInChI=1S/C18H29N3/c1-13(2)9-19-10-16-11-20-14(3)8-18(16)21(17-6-7-17)12-15-4-5-15/h8,11,13,15,17,19H,4-7,9-10,12H2,1-3H3
InChIKeyWVIVUGAAWLHGNR-UHFFFAOYSA-N
XLogP3.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-(propylaminomethyl)pyridin-4-amine
CID 81248139
N-cyclopentyl-N-ethyl-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 81249270
N-cyclopropyl-2-methyl-5-(methylaminomethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 81246744
N,2-dimethyl-5-[(2-methylpropylamino)methyl]-N-(oxolan-2-ylmethyl)pyridin-4-amine
CID 81249404
N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 64522855
N-cyclopropyl-N-(2-methoxyethyl)-2-methyl-5-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81246152
5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine
CID 81246878
N-cyclopropyl-N-(cyclopropylmethyl)-4-[(2-methylpropylamino)methyl]aniline
CID 64520020
N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine
CID 81247485
N-cyclopropyl-4-methyl-5-[(2-methylpropylamino)methyl]-N-propylpyrimidin-2-amine
CID 83185783
N-(cyclobutylmethyl)-N-ethyl-5-(ethylaminomethyl)-2-methylpyridin-4-amine
CID 107401789
N,2-dimethyl-N-(4-methylcyclohexyl)-5-(propylaminomethyl)pyridin-4-amine
CID 81253096

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine (CID 81254130) is N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine is Cc1cc(N(CC2CC2)C2CC2)c(CNCC(C)C)cn1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine?
The InChIKey is WVIVUGAAWLHGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-13(2)9-19-10-16-11-20-14(3)8-18(16)21(17-6-7-17)12-15-4-5-15/h8,11,13,15,17,19H,4-7,9-10,12H2,1-3H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine has a molecular weight of 287.45 g/mol, XLogP of 3.51, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine is sourced from PubChem (CID 81254130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).