N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine

C16H28N4 — CID 103131090

IUPACN-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
SMILESCNC(c1ccn(C)n1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H28N4/c1-17-15(14-8-13-19(2)18-14)16(9-4-5-10-16)20-11-6-3-7-12-20/h8,13,15,17H,3-7,9-12H2,1-2H3
InChIKeyBGCCAYVIFHZHRB-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.48
Rot. Bonds4

About N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine

N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine (PubChem CID 103131090) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
PubChem CID103131090
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
SMILESCNC(c1ccn(C)n1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H28N4/c1-17-15(14-8-13-19(2)18-14)16(9-4-5-10-16)20-11-6-3-7-12-20/h8,13,15,17H,3-7,9-12H2,1-2H3
InChIKeyBGCCAYVIFHZHRB-UHFFFAOYSA-N
XLogP2.48
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethoxycycloheptyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 103131455
1-(1-ethoxycyclopentyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 103131417
N-methyl-1-(3-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
CID 114688398
(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine
CID 103131092
[(1-methylcyclopentyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103140915
1-[ethylamino-(1-methylpyrazol-3-yl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 103131095
[2-(1-methylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethyl]hydrazine
CID 105242808
N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79059475
N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine
CID 79058952
[(1-ethylcyclopentyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103141044
N-methyl-1-(3-methylthiophen-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79988934
N-methyl-2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 82869589

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine?
The IUPAC name of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine (CID 103131090) is N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine is CNC(c1ccn(C)n1)C1(N2CCCCC2)CCCC1.
What is the InChIKey of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine?
The InChIKey is BGCCAYVIFHZHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-17-15(14-8-13-19(2)18-14)16(9-4-5-10-16)20-11-6-3-7-12-20/h8,13,15,17H,3-7,9-12H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine?
N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine has a molecular weight of 276.43 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine is sourced from PubChem (CID 103131090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).