1-[5-(dipropylamino)-2-pyridinyl]propan-1-one

C14H22N2O — CID 112583475

IUPAC1-[5-(dipropylamino)-2-pyridinyl]propan-1-one
SMILESCCCN(CCC)c1ccc(C(=O)CC)nc1
InChIInChI=1S/C14H22N2O/c1-4-9-16(10-5-2)12-7-8-13(15-11-12)14(17)6-3/h7-8,11H,4-6,9-10H2,1-3H3
InChIKeyRCRDDSXNBONGKF-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.30
Rot. Bonds7

About 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one

1-[5-(dipropylamino)-2-pyridinyl]propan-1-one (PubChem CID 112583475) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one.

Molecular Properties

Compound Name1-[5-(dipropylamino)-2-pyridinyl]propan-1-one
PubChem CID112583475
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[5-(dipropylamino)-2-pyridinyl]propan-1-one
SMILESCCCN(CCC)c1ccc(C(=O)CC)nc1
InChIInChI=1S/C14H22N2O/c1-4-9-16(10-5-2)12-7-8-13(15-11-12)14(17)6-3/h7-8,11H,4-6,9-10H2,1-3H3
InChIKeyRCRDDSXNBONGKF-UHFFFAOYSA-N
XLogP3.30
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[ethyl(propyl)amino]-2-pyridinyl]propan-1-one
CID 112583508
1-[5-(N-butylanilino)-2-pyridinyl]propan-1-one
CID 115939016
1-[5-(4-ethyl-N-methylanilino)-2-pyridinyl]propan-1-one
CID 115938975
1-[5-[prop-2-enyl(propyl)amino]-2-pyridinyl]ethanone
CID 83119863
N-benzyl-5-(dipropylamino)-N-ethylpyridine-2-carboxamide
CID 109190727
methyl 4-[[5-(dipropylamino)pyridine-2-carbonyl]amino]benzoate
CID 109196665
5-(dipropylamino)-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109196689
5-(dipropylamino)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109196630
N-benzyl-5-(dipropylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109195430
N'-hydroxy-5-[2-hydroxyethyl(propyl)amino]pyridine-2-carboximidamide
CID 136990539
1-[5-[cyclopropyl(cyclopropylmethyl)amino]-2-pyridinyl]propan-1-one
CID 112583682
CID 89241370
CID 89241370

Frequently Asked Questions

What is the IUPAC name of 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one?
The IUPAC name of 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one (CID 112583475) is 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one.
What is the SMILES notation for 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one?
The canonical SMILES for 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one is CCCN(CCC)c1ccc(C(=O)CC)nc1.
What is the InChIKey of 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one?
The InChIKey is RCRDDSXNBONGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-9-16(10-5-2)12-7-8-13(15-11-12)14(17)6-3/h7-8,11H,4-6,9-10H2,1-3H3.
What are the key properties of 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one?
1-[5-(dipropylamino)-2-pyridinyl]propan-1-one has a molecular weight of 234.34 g/mol, XLogP of 3.30, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(dipropylamino)-2-pyridinyl]propan-1-one is sourced from PubChem (CID 112583475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).