1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine

C23H32N4 — CID 119106658

IUPAC1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine
SMILESc1ccc2nc(N3CCCCC3)c(CNC3CCN(C4CC4)CC3)cc2c1
InChIInChI=1S/C23H32N4/c1-4-12-27(13-5-1)23-19(16-18-6-2-3-7-22(18)25-23)17-24-20-10-14-26(15-11-20)21-8-9-21/h2-3,6-7,16,20-21,24H,1,4-5,8-15,17H2
InChIKeyCNIRRIUCCAQWDS-UHFFFAOYSA-N
MW364.54 g/mol
LogP3.94
Rot. Bonds5

About 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine

1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine (PubChem CID 119106658) has the molecular formula C23H32N4 and a molecular weight of 364.54 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine
PubChem CID119106658
Molecular FormulaC23H32N4
Molecular Weight364.54 g/mol
Exact Mass364.26
IUPAC Name1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine
SMILESc1ccc2nc(N3CCCCC3)c(CNC3CCN(C4CC4)CC3)cc2c1
InChIInChI=1S/C23H32N4/c1-4-12-27(13-5-1)23-19(16-18-6-2-3-7-22(18)25-23)17-24-20-10-14-26(15-11-20)21-8-9-21/h2-3,6-7,16,20-21,24H,1,4-5,8-15,17H2
InChIKeyCNIRRIUCCAQWDS-UHFFFAOYSA-N
XLogP3.94
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.54
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Quipazine
CID 5011
4-Methyl-2-piperazin-1-yl-quinoline
CID 598754
N-Benzyl-2-phenyl-4-quinazolinamine
CID 780643
N2,N4-Dibenzylquinazoline-2,4-diamine
CID 676352
4-Methyl-2-(1-piperidinyl)quinoline
CID 230710
N-Methylquipazine
CID 5013
NSC 23766 trihydrochloride
CID 16759159
Importazole
CID 2949965
N6-[2-[5-(diethylamino)pentan-2-ylamino]-6-methyl-4-pyrimidinyl]-2-methylquinoline-4,6-diamine
CID 409805
4-Phenyl-2-(piperazin-1-yl)quinazoline
CID 3763388
Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
6-(4-Methyl-piperazin-1-yl)-phenanthridine
CID 9993659

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine (CID 119106658) is 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine is c1ccc2nc(N3CCCCC3)c(CNC3CCN(C4CC4)CC3)cc2c1.
What is the InChIKey of 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine?
The InChIKey is CNIRRIUCCAQWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4/c1-4-12-27(13-5-1)23-19(16-18-6-2-3-7-22(18)25-23)17-24-20-10-14-26(15-11-20)21-8-9-21/h2-3,6-7,16,20-21,24H,1,4-5,8-15,17H2.
What are the key properties of 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine?
1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine has a molecular weight of 364.54 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(2-piperidin-1-ylquinolin-3-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 119106658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).