N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine

C14H25N3 — CID 79090139

IUPACN-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(Nn2c(C)ccc2C)CC1
InChIInChI=1S/C14H25N3/c1-4-9-16-10-7-14(8-11-16)15-17-12(2)5-6-13(17)3/h5-6,14-15H,4,7-11H2,1-3H3
InChIKeyARAWCNSZUFQTFS-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.52
Rot. Bonds4

About N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine

N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine (PubChem CID 79090139) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine
PubChem CID79090139
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC NameN-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(Nn2c(C)ccc2C)CC1
InChIInChI=1S/C14H25N3/c1-4-9-16-10-7-14(8-11-16)15-17-12(2)5-6-13(17)3/h5-6,14-15H,4,7-11H2,1-3H3
InChIKeyARAWCNSZUFQTFS-UHFFFAOYSA-N
XLogP2.52
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(1-propylpiperidin-4-yl)benzenecarbothioamide
CID 173423133
N-[2-(2-methylphenyl)ethyl]-1-propylpiperidin-4-amine
CID 78911476
N-[1-(4-methylphenyl)ethyl]-1-propylpiperidin-4-amine
CID 43206682
N-(3,3-diphenylpropyl)-1-propylpiperidin-4-amine
CID 2846321
1-propyl-N-[(1-propylpyrrol-3-yl)methyl]piperidin-4-amine
CID 66397545
N-(2-methyl-3-pyridinyl)-1-propylazepan-4-amine
CID 79041986
3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 17249825
N-(2-bromo-6-fluorophenyl)-1-propylpiperidin-4-amine
CID 107598285
6-hydrazinyl-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 80897058
N-[1-(5-methylfuran-2-yl)ethyl]-1-propylpiperidin-4-amine
CID 43182992
4-methylsulfonyl-N-(1-propylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 55538300
2,6-dimethyl-3-[(1-propylpiperidin-4-yl)amino]phenol
CID 43741721

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine?
The IUPAC name of N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine (CID 79090139) is N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine.
What is the SMILES notation for N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine?
The canonical SMILES for N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine is CCCN1CCC(Nn2c(C)ccc2C)CC1.
What is the InChIKey of N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine?
The InChIKey is ARAWCNSZUFQTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-9-16-10-7-14(8-11-16)15-17-12(2)5-6-13(17)3/h5-6,14-15H,4,7-11H2,1-3H3.
What are the key properties of N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine?
N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine has a molecular weight of 235.38 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine is sourced from PubChem (CID 79090139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).