4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide

C14H20N4O — CID 47071641

IUPAC4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccncc1)N1CCN(CC2CC2)CC1
InChIInChI=1S/C14H20N4O/c19-14(16-13-3-5-15-6-4-13)18-9-7-17(8-10-18)11-12-1-2-12/h3-6,12H,1-2,7-11H2,(H,15,16,19)
InChIKeyBIJUTLNCRMPDPF-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.64
Rot. Bonds3

About 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide

4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide (PubChem CID 47071641) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide
PubChem CID47071641
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccncc1)N1CCN(CC2CC2)CC1
InChIInChI=1S/C14H20N4O/c19-14(16-13-3-5-15-6-4-13)18-9-7-17(8-10-18)11-12-1-2-12/h3-6,12H,1-2,7-11H2,(H,15,16,19)
InChIKeyBIJUTLNCRMPDPF-UHFFFAOYSA-N
XLogP1.64
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropylmethyl)-N-(3,5-dibromophenyl)-1,4-diazepane-1-carboxamide
CID 141138542
(4-amino-3-pyridinyl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone
CID 81239759
4-(azepan-1-ylmethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
CID 20907581
4-(propylamino)-N-pyridin-4-ylpiperidine-1-carboxamide
CID 143091421
2-[[4-(cyclopropylmethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylic acid
CID 63114341
4-[(1-methylpiperidin-3-yl)methyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 11581776
4-(cyclopropylmethyl)-N-(pyridin-3-ylmethoxy)piperazine-1-carboxamide
CID 91661392
3-[(4-fluorophenyl)methyl]-N-pyridin-4-ylpyrrolidine-1-carboxamide
CID 138996907
4-[(2-methylphenyl)sulfonylmethyl]-N-pyridin-4-ylpiperidine-1-carboxamide
CID 122430799
4-(cyclohexylmethyl)-N-(2,6-dimethyl-3-pyridinyl)piperazine-1-carboxamide
CID 126777645
N-(6-ethoxy-3-pyridinyl)-4-(oxolan-3-ylmethyl)piperazine-1-carboxamide
CID 126781942
4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]methyl]-N-phenylpiperidine-1-carboxamide
CID 92731331

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide?
The IUPAC name of 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide (CID 47071641) is 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide?
The canonical SMILES for 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide is O=C(Nc1ccncc1)N1CCN(CC2CC2)CC1.
What is the InChIKey of 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide?
The InChIKey is BIJUTLNCRMPDPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c19-14(16-13-3-5-15-6-4-13)18-9-7-17(8-10-18)11-12-1-2-12/h3-6,12H,1-2,7-11H2,(H,15,16,19).
What are the key properties of 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide?
4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethyl)-N-pyridin-4-ylpiperazine-1-carboxamide is sourced from PubChem (CID 47071641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).