1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine

C12H21NO — CID 102647237

IUPAC1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
SMILESCNC(C1=CCCCO1)C1CCCC1
InChIInChI=1S/C12H21NO/c1-13-12(10-6-2-3-7-10)11-8-4-5-9-14-11/h8,10,12-13H,2-7,9H2,1H3
InChIKeyFJCVAEHVUQNKRJ-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.46
Rot. Bonds3

About 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine

1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine (PubChem CID 102647237) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
PubChem CID102647237
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
SMILESCNC(C1=CCCCO1)C1CCCC1
InChIInChI=1S/C12H21NO/c1-13-12(10-6-2-3-7-10)11-8-4-5-9-14-11/h8,10,12-13H,2-7,9H2,1H3
InChIKeyFJCVAEHVUQNKRJ-UHFFFAOYSA-N
XLogP2.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 102649506
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 102649615
N-[(4,4-difluorocyclohexyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]propan-1-amine
CID 102649634
1-(4,4-difluorocyclohexyl)-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102652898
N-[2,3-dihydrofuran-5-yl-[2-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 102652911
N-[2,3-dihydrofuran-5-yl-[4-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 102653035
N-[2,3-dihydrofuran-5-yl-[4-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 102653093
N-[2,3-dihydrofuran-5-yl-[2-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 102653443
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 102653549
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 102653661
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 102653769
N-[(4,4-difluorocyclohexyl)-(2,3-dihydrofuran-5-yl)methyl]ethanamine
CID 102653779

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine (CID 102647237) is 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine is CNC(C1=CCCCO1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The InChIKey is FJCVAEHVUQNKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-13-12(10-6-2-3-7-10)11-8-4-5-9-14-11/h8,10,12-13H,2-7,9H2,1H3.
What are the key properties of 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine has a molecular weight of 195.31 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine is sourced from PubChem (CID 102647237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).