N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine

C17H32N4 — CID 114718631

IUPACN,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine
SMILESCC(C)CC(CN(C)C)n1cncc1C1(C)CCNCC1
InChIInChI=1S/C17H32N4/c1-14(2)10-15(12-20(4)5)21-13-19-11-16(21)17(3)6-8-18-9-7-17/h11,13-15,18H,6-10,12H2,1-5H3
InChIKeyISGBKVGKXZJUNM-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.67
Rot. Bonds6

About N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine

N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine (PubChem CID 114718631) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine
PubChem CID114718631
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC NameN,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine
SMILESCC(C)CC(CN(C)C)n1cncc1C1(C)CCNCC1
InChIInChI=1S/C17H32N4/c1-14(2)10-15(12-20(4)5)21-13-19-11-16(21)17(3)6-8-18-9-7-17/h11,13-15,18H,6-10,12H2,1-5H3
InChIKeyISGBKVGKXZJUNM-UHFFFAOYSA-N
XLogP2.67
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine?
The IUPAC name of N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine (CID 114718631) is N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine.
What is the SMILES notation for N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine?
The canonical SMILES for N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine is CC(C)CC(CN(C)C)n1cncc1C1(C)CCNCC1.
What is the InChIKey of N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine?
The InChIKey is ISGBKVGKXZJUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-14(2)10-15(12-20(4)5)21-13-19-11-16(21)17(3)6-8-18-9-7-17/h11,13-15,18H,6-10,12H2,1-5H3.
What are the key properties of N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine?
N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine has a molecular weight of 292.47 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]pentan-1-amine is sourced from PubChem (CID 114718631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).