N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine

C13H24N4 — CID 79069835

IUPACN,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
SMILESCNC(c1cnn(C)c1)C1(N(C)C)CCCC1
InChIInChI=1S/C13H24N4/c1-14-12(11-9-15-17(4)10-11)13(16(2)3)7-5-6-8-13/h9-10,12,14H,5-8H2,1-4H3
InChIKeyIXECSDBCQQZUNU-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.55
Rot. Bonds4

About N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine

N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine (PubChem CID 79069835) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
PubChem CID79069835
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
SMILESCNC(c1cnn(C)c1)C1(N(C)C)CCCC1
InChIInChI=1S/C13H24N4/c1-14-12(11-9-15-17(4)10-11)13(16(2)3)7-5-6-8-13/h9-10,12,14H,5-8H2,1-4H3
InChIKeyIXECSDBCQQZUNU-UHFFFAOYSA-N
XLogP1.55
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine?
The IUPAC name of N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine (CID 79069835) is N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine is CNC(c1cnn(C)c1)C1(N(C)C)CCCC1.
What is the InChIKey of N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine?
The InChIKey is IXECSDBCQQZUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-14-12(11-9-15-17(4)10-11)13(16(2)3)7-5-6-8-13/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine?
N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 79069835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).