N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine

C14H27NO — CID 114534707

IUPACN-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine
SMILESCC(C)NCC1(C2CCCC2)CCOC1C
InChIInChI=1S/C14H27NO/c1-11(2)15-10-14(8-9-16-12(14)3)13-6-4-5-7-13/h11-13,15H,4-10H2,1-3H3
InChIKeySPXWOJWFBBCBPG-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds4

About N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine

N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine (PubChem CID 114534707) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine
PubChem CID114534707
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine
SMILESCC(C)NCC1(C2CCCC2)CCOC1C
InChIInChI=1S/C14H27NO/c1-11(2)15-10-14(8-9-16-12(14)3)13-6-4-5-7-13/h11-13,15H,4-10H2,1-3H3
InChIKeySPXWOJWFBBCBPG-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-cyclohexyl-2-methyloxolan-3-yl)methyl]propan-1-amine
CID 114534503
N-[(3-cyclopropyl-2-methyloxolan-3-yl)methyl]propan-1-amine
CID 114534548
N-[(1-cyclohexylcyclohexyl)methyl]propan-2-amine
CID 82933466
N-[(3-cycloheptyloxolan-3-yl)methyl]propan-2-amine
CID 82934192
N-[(2-cyclopentyl-2-bicyclo[2.2.1]heptanyl)methyl]propan-2-amine
CID 82933969
N-[[3-[3-(2-methoxyethoxy)propyl]-2-methyloxolan-3-yl]methyl]propan-2-amine
CID 103412751
N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
CID 106706225
N-[[3-(3-ethylsulfonylpropyl)-2-methyloxolan-3-yl]methyl]propan-2-amine
CID 114534670
N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine
CID 104509924
N-[[3-(2-tert-butylsulfonylethyl)-2-methyloxolan-3-yl]methyl]propan-2-amine
CID 106730407
N-[[3-[(4-fluorophenyl)methyl]-2-methyloxolan-3-yl]methyl]propan-2-amine
CID 114534661
3-(bromomethyl)-3-cyclopentyl-2-cyclopropyloxolane
CID 104510773

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine?
The IUPAC name of N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine (CID 114534707) is N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine is CC(C)NCC1(C2CCCC2)CCOC1C.
What is the InChIKey of N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine?
The InChIKey is SPXWOJWFBBCBPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11(2)15-10-14(8-9-16-12(14)3)13-6-4-5-7-13/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine?
N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopentyl-2-methyloxolan-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 114534707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).