(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine

C14H20N2 — CID 28660896

IUPAC(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine
SMILESC[C@H](NC(C1CC1)C1CC1)c1ccccn1
InChIInChI=1S/C14H20N2/c1-10(13-4-2-3-9-15-13)16-14(11-5-6-11)12-7-8-12/h2-4,9-12,14,16H,5-8H2,1H3/t10-/m0/s1
InChIKeyZJGHPBMKCMRCJU-JTQLQIEISA-N
MW216.33 g/mol
LogP2.92
Rot. Bonds5

About (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine

(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine (PubChem CID 28660896) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine
PubChem CID28660896
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine
SMILESC[C@H](NC(C1CC1)C1CC1)c1ccccn1
InChIInChI=1S/C14H20N2/c1-10(13-4-2-3-9-15-13)16-14(11-5-6-11)12-7-8-12/h2-4,9-12,14,16H,5-8H2,1H3/t10-/m0/s1
InChIKeyZJGHPBMKCMRCJU-JTQLQIEISA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]butan-2-amine
CID 28648178
1-cyclopropyl-2-methoxy-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81402259
N-(1-iodoethyl)-1-pyridin-2-ylethanamine
CID 174262770
1-(oxolan-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]ethanamine
CID 104865520
1-cyclopropyl-2-(1-pyridin-2-ylethylamino)ethanol
CID 63294348
N-[(1S)-1-pyridin-2-ylethyl]cyclododecanamine
CID 29052683
N-[(1S)-1-pyridin-2-ylethyl]cycloheptanamine
CID 28647798
N-(1-pyridin-2-ylethyl)cyclooctanamine
CID 43178142
1-[(1S)-1-cyclopropylethyl]-3-[(1R)-1-pyridin-2-ylethyl]urea
CID 36970118
1-[(1S)-1-cyclopropylethyl]-3-[(1S)-1-pyridin-2-ylethyl]urea
CID 36970112
(1R)-N-[(S)-cyclopropyl-(4-fluoro-3-methylphenyl)methyl]-1-pyridin-2-ylethanamine
CID 129471403
N-(cyclopropylmethyl)-1-pyridin-2-ylethanamine
CID 21278980

Frequently Asked Questions

What is the IUPAC name of (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine?
The IUPAC name of (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine (CID 28660896) is (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine.
What is the SMILES notation for (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine?
The canonical SMILES for (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine is C[C@H](NC(C1CC1)C1CC1)c1ccccn1.
What is the InChIKey of (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine?
The InChIKey is ZJGHPBMKCMRCJU-JTQLQIEISA-N. The full InChI is InChI=1S/C14H20N2/c1-10(13-4-2-3-9-15-13)16-14(11-5-6-11)12-7-8-12/h2-4,9-12,14,16H,5-8H2,1H3/t10-/m0/s1.
What are the key properties of (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine?
(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine has a molecular weight of 216.33 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine is sourced from PubChem (CID 28660896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).