1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine

C16H27N3 — CID 79070030

IUPAC1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCN(CC)C1(C(N)c2ccc(C)nc2)CCCC1
InChIInChI=1S/C16H27N3/c1-4-19(5-2)16(10-6-7-11-16)15(17)14-9-8-13(3)18-12-14/h8-9,12,15H,4-7,10-11,17H2,1-3H3
InChIKeyMRJRLWJTFSLBGU-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.04
Rot. Bonds5

About 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine

1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine (PubChem CID 79070030) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine
PubChem CID79070030
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCN(CC)C1(C(N)c2ccc(C)nc2)CCCC1
InChIInChI=1S/C16H27N3/c1-4-19(5-2)16(10-6-7-11-16)15(17)14-9-8-13(3)18-12-14/h8-9,12,15H,4-7,10-11,17H2,1-3H3
InChIKeyMRJRLWJTFSLBGU-UHFFFAOYSA-N
XLogP3.04
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-1-[hydrazinyl-(6-methyl-3-pyridinyl)methyl]cyclopentan-1-amine
CID 105242677
1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79074764
1-[amino-(1-methylpyrazol-4-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79069951
1-[amino-(1-propylimidazol-2-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79069803
1-[amino-(2-ethoxyphenyl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79059165
1-[amino-(4-bromo-1-methylpyrazol-5-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 114657001
1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 115854871
1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine
CID 83908685
[(1-methylcyclopentyl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305467
1-[amino(cyclohexen-1-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 106653676
1-[amino-(3-bromo-2,6-difluorophenyl)methyl]-N,N-diethylcyclopentan-1-amine
CID 106942748
1-[amino-(4-bromothiophen-3-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79601627

Frequently Asked Questions

What is the IUPAC name of 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine (CID 79070030) is 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine is CCN(CC)C1(C(N)c2ccc(C)nc2)CCCC1.
What is the InChIKey of 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine?
The InChIKey is MRJRLWJTFSLBGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-19(5-2)16(10-6-7-11-16)15(17)14-9-8-13(3)18-12-14/h8-9,12,15H,4-7,10-11,17H2,1-3H3.
What are the key properties of 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine?
1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 79070030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).