N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine

C17H30N4 — CID 79059475

IUPACN-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
SMILESCCCn1nccc1C(NC)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H30N4/c1-3-12-21-15(8-11-19-21)16(18-2)17(9-4-5-10-17)20-13-6-7-14-20/h8,11,16,18H,3-7,9-10,12-14H2,1-2H3
InChIKeyKRFJPXYXHZQPEW-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.96
Rot. Bonds6

About N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine

N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine (PubChem CID 79059475) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
PubChem CID79059475
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC NameN-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
SMILESCCCn1nccc1C(NC)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H30N4/c1-3-12-21-15(8-11-19-21)16(18-2)17(9-4-5-10-17)20-13-6-7-14-20/h8,11,16,18H,3-7,9-10,12-14H2,1-2H3
InChIKeyKRFJPXYXHZQPEW-UHFFFAOYSA-N
XLogP2.96
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 104610857
[(1-methylcyclopropyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105253298
N-methyl-1-(3-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
CID 114688398
1-(2,2-dimethylcyclohexyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 107188799
1-(furan-3-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79060580
N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
CID 103131090
(2-methyloxan-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 80683782
(2-propylpyrazol-3-yl)-(1-pyrrolidin-1-ylcyclopentyl)methanone
CID 79060145
(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol
CID 116753279
(1-piperidin-1-ylcyclopentyl)-(3-propyltriazol-4-yl)methanol
CID 114686588
1-(2-ethylpyrazol-3-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
CID 63977043
2-ethylsulfanyl-N-methyl-1-(2-propylpyrazol-3-yl)ethanamine
CID 65128079

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The IUPAC name of N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine (CID 79059475) is N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine.
What is the SMILES notation for N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The canonical SMILES for N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine is CCCn1nccc1C(NC)C1(N2CCCC2)CCCC1.
What is the InChIKey of N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The InChIKey is KRFJPXYXHZQPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-3-12-21-15(8-11-19-21)16(18-2)17(9-4-5-10-17)20-13-6-7-14-20/h8,11,16,18H,3-7,9-10,12-14H2,1-2H3.
What are the key properties of N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine has a molecular weight of 290.45 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine is sourced from PubChem (CID 79059475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).