(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine

C12H18N2 — CID 28655253

IUPAC(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
SMILESC[C@@H](N[C@H](C)C1CC1)c1cccnc1
InChIInChI=1S/C12H18N2/c1-9(11-5-6-11)14-10(2)12-4-3-7-13-8-12/h3-4,7-11,14H,5-6H2,1-2H3/t9-,10-/m1/s1
InChIKeyDZTGBHSBLZQCHK-NXEZZACHSA-N
MW190.29 g/mol
LogP2.53
Rot. Bonds4

About (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine

(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine (PubChem CID 28655253) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
PubChem CID28655253
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
SMILESC[C@@H](N[C@H](C)C1CC1)c1cccnc1
InChIInChI=1S/C12H18N2/c1-9(11-5-6-11)14-10(2)12-4-3-7-13-8-12/h3-4,7-11,14H,5-6H2,1-2H3/t9-,10-/m1/s1
InChIKeyDZTGBHSBLZQCHK-NXEZZACHSA-N
XLogP2.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine with MolForge

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Related Compounds

1-(1-propylpiperidin-4-yl)-N-(1-pyridin-3-ylethyl)ethanamine
CID 43308271
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
(1S)-1-phenyl-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 11413502
2-cyclopropyl-N-(1-pyridin-3-ylethyl)propan-1-amine
CID 115623727
1-(2-bicyclo[2.2.1]hept-5-enyl)-N-(1-pyridin-3-ylethyl)ethanamine
CID 43768140
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773
N-[1-(1-methylcyclopropyl)ethyl]-1-pyridin-3-ylethanamine
CID 43363226
1-(4-bromophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 79690838
1-(4-fluorophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 81406480
1-(4-iodophenyl)-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 81345023

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine?
The IUPAC name of (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine (CID 28655253) is (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine.
What is the SMILES notation for (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine?
The canonical SMILES for (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine is C[C@@H](N[C@H](C)C1CC1)c1cccnc1.
What is the InChIKey of (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine?
The InChIKey is DZTGBHSBLZQCHK-NXEZZACHSA-N. The full InChI is InChI=1S/C12H18N2/c1-9(11-5-6-11)14-10(2)12-4-3-7-13-8-12/h3-4,7-11,14H,5-6H2,1-2H3/t9-,10-/m1/s1.
What are the key properties of (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine?
(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine is sourced from PubChem (CID 28655253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).