1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine

C15H28N4 — CID 66134778

IUPAC1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
SMILESCCCN1CCC(NCc2cncn2CCC)CC1
InChIInChI=1S/C15H28N4/c1-3-7-18-9-5-14(6-10-18)17-12-15-11-16-13-19(15)8-4-2/h11,13-14,17H,3-10,12H2,1-2H3
InChIKeyIDRUUSHRZWAPEZ-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.26
Rot. Bonds7

About 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine

1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine (PubChem CID 66134778) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
PubChem CID66134778
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
SMILESCCCN1CCC(NCc2cncn2CCC)CC1
InChIInChI=1S/C15H28N4/c1-3-7-18-9-5-14(6-10-18)17-12-15-11-16-13-19(15)8-4-2/h11,13-14,17H,3-10,12H2,1-2H3
InChIKeyIDRUUSHRZWAPEZ-UHFFFAOYSA-N
XLogP2.26
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-butyl-N-[(3-ethylimidazol-4-yl)methyl]piperidin-4-amine
CID 66133818
4-propyl-N-[(3-propylimidazol-4-yl)methyl]cyclohexan-1-amine
CID 66129378
N-[(3-propylimidazol-4-yl)methyl]cyclohex-3-en-1-amine
CID 66129398
2-methyl-1-[4-[(3-propylimidazol-4-yl)methylamino]piperidin-1-yl]propan-1-one
CID 66130556
3-[(3-propylimidazol-4-yl)methylamino]cyclobutan-1-ol
CID 66129997
N-[(3-methyltriazol-4-yl)methyl]-1-propylpiperidin-4-amine
CID 115682188
2,2,6,6-tetramethyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
CID 66134567
3-(4-methylpiperidin-1-yl)-N-[(3-propylimidazol-4-yl)methyl]propan-1-amine
CID 66134575
N-[[3-[3-(diethylamino)propyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66146507
N-[(3-propylimidazol-4-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 66130357
2-methyl-N-[(3-propylimidazol-4-yl)methyl]cycloheptan-1-amine
CID 66129396
N-[[3-[(1-methylpiperidin-4-yl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66150734

Frequently Asked Questions

What is the IUPAC name of 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine (CID 66134778) is 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine is CCCN1CCC(NCc2cncn2CCC)CC1.
What is the InChIKey of 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine?
The InChIKey is IDRUUSHRZWAPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-3-7-18-9-5-14(6-10-18)17-12-15-11-16-13-19(15)8-4-2/h11,13-14,17H,3-10,12H2,1-2H3.
What are the key properties of 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine?
1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine has a molecular weight of 264.42 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 66134778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).