1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine

C14H25N3O — CID 104610857

IUPAC1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
SMILESCCCn1nccc1C(NC)C1(OC)CCCC1
InChIInChI=1S/C14H25N3O/c1-4-11-17-12(7-10-16-17)13(15-2)14(18-3)8-5-6-9-14/h7,10,13,15H,4-6,8-9,11H2,1-3H3
InChIKeyVDUBPUBQQKOCOB-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.51
Rot. Bonds6

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

1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine (PubChem CID 104610857) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
PubChem CID104610857
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
SMILESCCCn1nccc1C(NC)C1(OC)CCCC1
InChIInChI=1S/C14H25N3O/c1-4-11-17-12(7-10-16-17)13(15-2)14(18-3)8-5-6-9-14/h7,10,13,15H,4-6,8-9,11H2,1-3H3
InChIKeyVDUBPUBQQKOCOB-UHFFFAOYSA-N
XLogP2.51
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol
CID 116753279
N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79059475
N-[(2-ethylpyrazol-3-yl)-(1-methoxycycloheptyl)methyl]ethanamine
CID 116770400
[(1-methylcyclopropyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105253298
1-(2,2-dimethylcyclohexyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 107188799
[(1-methoxycyclobutyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105270208
1-(4-chloro-1-propylpyrazol-5-yl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
CID 114661992
(2-methyloxan-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 80683782
1-(2,6-dimethoxyphenyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 115857493
[(1-methoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105268662
1-(4-bromo-1-ethylpyrazol-5-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine
CID 114660920
[(1-methoxycyclohexyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105275993

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine?
The IUPAC name of 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine (CID 104610857) is 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine.
What is the SMILES notation for 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine?
The canonical SMILES for 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine is CCCn1nccc1C(NC)C1(OC)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine?
The InChIKey is VDUBPUBQQKOCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-4-11-17-12(7-10-16-17)13(15-2)14(18-3)8-5-6-9-14/h7,10,13,15H,4-6,8-9,11H2,1-3H3.
What are the key properties of 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine?
1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine has a molecular weight of 251.37 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine is sourced from PubChem (CID 104610857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).