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

C14H29N — CID 81034843

IUPACN-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine
SMILESCC(C)CCC1CCCC1CNC(C)C
InChIInChI=1S/C14H29N/c1-11(2)8-9-13-6-5-7-14(13)10-15-12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyRVUFVLDYVJKODA-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.84
Rot. Bonds6

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

N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine (PubChem CID 81034843) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine
PubChem CID81034843
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine
SMILESCC(C)CCC1CCCC1CNC(C)C
InChIInChI=1S/C14H29N/c1-11(2)8-9-13-6-5-7-14(13)10-15-12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyRVUFVLDYVJKODA-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-ethylcyclopentyl)methyl]propan-2-amine
CID 58787055
N-[[2-(3-methylbut-3-enyl)cyclopentyl]methyl]propan-2-amine
CID 114477712
1-(3-methylbutyl)-2-(2-methylpropyl)cyclohexane
CID 59745597
2-[(propan-2-ylamino)methyl]cyclopentan-1-ol
CID 13133892
N-[[2-(cyclohexylmethyl)cyclopentyl]methyl]propan-2-amine
CID 81034855
N-[[(1R,2R)-2-(4-methylpentyl)cyclopropyl]methyl]propan-2-amine
CID 118618598
N-[[2-(2-propan-2-ylsulfanylethyl)cycloheptyl]methyl]propan-2-amine
CID 114268931
N-cyclopropyl-2-(3-methylbutyl)cyclopentan-1-amine
CID 115704595
N-[[2-[3-(2,2,2-trifluoroethoxy)propyl]cyclopentyl]methyl]propan-2-amine
CID 81033222
N-[[2-(3-methoxypropyl)cyclobutyl]methyl]propan-2-amine
CID 81017330
N-[(2-methoxycyclopentyl)methyl]propan-2-amine
CID 170206706
2-(3-methylbutyl)-N-propylcyclopentan-1-amine
CID 61381970

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine (CID 81034843) is N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine is CC(C)CCC1CCCC1CNC(C)C.
What is the InChIKey of N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine?
The InChIKey is RVUFVLDYVJKODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-11(2)8-9-13-6-5-7-14(13)10-15-12(3)4/h11-15H,5-10H2,1-4H3.
What are the key properties of N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine?
N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine is sourced from PubChem (CID 81034843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).