5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine

C17H23N3 — CID 80633726

IUPAC5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine
SMILESCCN(Cc1ccccc1)c1ccc(CC(C)N)cn1
InChIInChI=1S/C17H23N3/c1-3-20(13-15-7-5-4-6-8-15)17-10-9-16(12-19-17)11-14(2)18/h4-10,12,14H,3,11,13,18H2,1-2H3
InChIKeyCNKYZCRPQHZKQB-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.00
Rot. Bonds6

About 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine

5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine (PubChem CID 80633726) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine
PubChem CID80633726
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine
SMILESCCN(Cc1ccccc1)c1ccc(CC(C)N)cn1
InChIInChI=1S/C17H23N3/c1-3-20(13-15-7-5-4-6-8-15)17-10-9-16(12-19-17)11-14(2)18/h4-10,12,14H,3,11,13,18H2,1-2H3
InChIKeyCNKYZCRPQHZKQB-UHFFFAOYSA-N
XLogP3.00
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-aminopropyl)-N-butan-2-yl-N-methylpyridin-2-amine
CID 80633292
5-(2-aminopropyl)-N-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
CID 80633800
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-methylpropanamide
CID 113012566
1-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3-propan-2-ylurea
CID 113012624
6-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-3-carboxamide
CID 109152040
5-(2-aminopropyl)-N-cyclopentyl-N-ethylpyridin-2-amine
CID 80633967
5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
CID 80634325
1-(6-phenylmethoxy-3-pyridinyl)propan-2-amine
CID 71131754
5-(2-aminopropyl)-N-methyl-N-pentylpyridin-2-amine
CID 80633509
5-(2-aminopropyl)-N-(2-methylpropyl)-N-pentan-3-ylpyridin-2-amine
CID 80634906
2-amino-N-[6-[benzyl(ethyl)amino]-3-pyridinyl]acetamide
CID 39181885
λ2-plumbane;1-phenylpropan-2-amine
CID 174896483

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine?
The IUPAC name of 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine (CID 80633726) is 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine?
The canonical SMILES for 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine is CCN(Cc1ccccc1)c1ccc(CC(C)N)cn1.
What is the InChIKey of 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine?
The InChIKey is CNKYZCRPQHZKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-20(13-15-7-5-4-6-8-15)17-10-9-16(12-19-17)11-14(2)18/h4-10,12,14H,3,11,13,18H2,1-2H3.
What are the key properties of 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine?
5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine is sourced from PubChem (CID 80633726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).