N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine

C16H25N3 — CID 107401850

IUPACN-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
SMILESCCN(CC1CCC1)c1ncccc1CNC1CC1
InChIInChI=1S/C16H25N3/c1-2-19(12-13-5-3-6-13)16-14(7-4-10-17-16)11-18-15-8-9-15/h4,7,10,13,15,18H,2-3,5-6,8-9,11-12H2,1H3
InChIKeyCIQAZHBSZFSRTH-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.96
Rot. Bonds7

About N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine

N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine (PubChem CID 107401850) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
PubChem CID107401850
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC NameN-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
SMILESCCN(CC1CCC1)c1ncccc1CNC1CC1
InChIInChI=1S/C16H25N3/c1-2-19(12-13-5-3-6-13)16-14(7-4-10-17-16)11-18-15-8-9-15/h4,7,10,13,15,18H,2-3,5-6,8-9,11-12H2,1H3
InChIKeyCIQAZHBSZFSRTH-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(cyclopropylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 62280348
3-[(cyclopropylamino)methyl]-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 62283336
3-bromo-N-(cyclobutylmethyl)-N-ethylpyridin-2-amine
CID 107400762
3-[(cyclopropylamino)methyl]-N-methyl-N-propan-2-ylpyridin-2-amine
CID 62284786
3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
CID 62287807
5-chloro-N-(cyclobutylmethyl)-4-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 107401902
N-(cyclobutylmethyl)-5-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 107399965
3-chloro-N-(cyclopropylmethyl)-N-ethylpyrazin-2-amine
CID 63956678
N-(cyclobutylmethyl)-4-[(cyclopropylamino)methyl]-N-ethylaniline
CID 107399942
N,N-dimethyl-3-[(oxan-4-ylamino)methyl]pyridin-2-amine
CID 29153314
N-[[2-[[cyclobutylmethyl(methyl)amino]methyl]phenyl]methyl]cyclopropanamine
CID 62856940
3-[(cyclobutylamino)methyl]pyridin-2-amine
CID 117212619

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine (CID 107401850) is N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine is CCN(CC1CCC1)c1ncccc1CNC1CC1.
What is the InChIKey of N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine?
The InChIKey is CIQAZHBSZFSRTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-2-19(12-13-5-3-6-13)16-14(7-4-10-17-16)11-18-15-8-9-15/h4,7,10,13,15,18H,2-3,5-6,8-9,11-12H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine?
N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine has a molecular weight of 259.40 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 107401850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).