N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine

C10H14N2 — CID 26385082

IUPACN-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
SMILESC[C@H](NC1CC1)c1cccnc1
InChIInChI=1S/C10H14N2/c1-8(12-10-4-5-10)9-3-2-6-11-7-9/h2-3,6-8,10,12H,4-5H2,1H3/t8-/m0/s1
InChIKeyXJCXOPUZWYXCES-QMMMGPOBSA-N
MW162.24 g/mol
LogP1.89
Rot. Bonds3

About N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine

N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine (PubChem CID 26385082) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
PubChem CID26385082
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
SMILESC[C@H](NC1CC1)c1cccnc1
InChIInChI=1S/C10H14N2/c1-8(12-10-4-5-10)9-3-2-6-11-7-9/h2-3,6-8,10,12H,4-5H2,1H3/t8-/m0/s1
InChIKeyXJCXOPUZWYXCES-QMMMGPOBSA-N
XLogP1.89
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
3-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1,3-diamine
CID 81406551
4-propyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 28655963
N-[(1R)-1-pyridin-3-ylethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 81407407
N-[(1S)-1-pyridin-3-ylethyl]azetidin-3-amine
CID 81406806
1-propan-2-yl-N-[(1S)-1-pyridin-3-ylethyl]piperidin-4-amine
CID 28716728
1,1-dioxo-N-[(1R)-1-pyridin-3-ylethyl]thian-4-amine
CID 81404409
1,1-dioxo-N-[(1S)-1-pyridin-3-ylethyl]thian-4-amine
CID 81406804
4-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cycloheptan-1-amine
CID 81407640
N-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 79724749
N-(1-pyridin-3-ylethyl)spiro[4.5]decan-8-amine
CID 114817153

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine?
The IUPAC name of N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine (CID 26385082) is N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine.
What is the SMILES notation for N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine?
The canonical SMILES for N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine is C[C@H](NC1CC1)c1cccnc1.
What is the InChIKey of N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine?
The InChIKey is XJCXOPUZWYXCES-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H14N2/c1-8(12-10-4-5-10)9-3-2-6-11-7-9/h2-3,6-8,10,12H,4-5H2,1H3/t8-/m0/s1.
What are the key properties of N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine?
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine has a molecular weight of 162.24 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine is sourced from PubChem (CID 26385082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).