N-(1-cyclopropylpropyl)-2-methylpentan-3-amine

C12H25N — CID 64917590

IUPACN-(1-cyclopropylpropyl)-2-methylpentan-3-amine
SMILESCCC(NC(CC)C1CC1)C(C)C
InChIInChI=1S/C12H25N/c1-5-11(9(3)4)13-12(6-2)10-7-8-10/h9-13H,5-8H2,1-4H3
InChIKeySYKPSRVQNDBMKH-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds6

About N-(1-cyclopropylpropyl)-2-methylpentan-3-amine

N-(1-cyclopropylpropyl)-2-methylpentan-3-amine (PubChem CID 64917590) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N-(1-cyclopropylpropyl)-2-methylpentan-3-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropyl)-2-methylpentan-3-amine
PubChem CID64917590
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN-(1-cyclopropylpropyl)-2-methylpentan-3-amine
SMILESCCC(NC(CC)C1CC1)C(C)C
InChIInChI=1S/C12H25N/c1-5-11(9(3)4)13-12(6-2)10-7-8-10/h9-13H,5-8H2,1-4H3
InChIKeySYKPSRVQNDBMKH-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
CID 103871687
1-cyclopropyl-N-methylpropan-1-amine
CID 20693438
N-(1-cyclopropylbutyl)-1-methoxy-3-methylbutan-2-amine
CID 115770061
1-(4-propan-2-ylcyclohexyl)-N-propylpropan-1-amine
CID 65424395
1-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)propan-1-amine
CID 115895248
N-(1-cyclopropylpropyl)-4-methylsulfanylbutan-2-amine
CID 115722054
methyl (2S)-2-(1-cyclopropylpropylamino)propanoate
CID 64920130
N-(1-cyclopropylpropyl)hydroxylamine
CID 82686074
N-(1-cyclopropylpropyl)-4-methoxy-4-methylpentan-2-amine
CID 115724125
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115724005
2-(1-cyclopropylpropylamino)-N-propylpropanamide
CID 64917765
1-cyclopropyl-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]propan-1-amine
CID 64919929

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropyl)-2-methylpentan-3-amine?
The IUPAC name of N-(1-cyclopropylpropyl)-2-methylpentan-3-amine (CID 64917590) is N-(1-cyclopropylpropyl)-2-methylpentan-3-amine.
What is the SMILES notation for N-(1-cyclopropylpropyl)-2-methylpentan-3-amine?
The canonical SMILES for N-(1-cyclopropylpropyl)-2-methylpentan-3-amine is CCC(NC(CC)C1CC1)C(C)C.
What is the InChIKey of N-(1-cyclopropylpropyl)-2-methylpentan-3-amine?
The InChIKey is SYKPSRVQNDBMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-11(9(3)4)13-12(6-2)10-7-8-10/h9-13H,5-8H2,1-4H3.
What are the key properties of N-(1-cyclopropylpropyl)-2-methylpentan-3-amine?
N-(1-cyclopropylpropyl)-2-methylpentan-3-amine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropyl)-2-methylpentan-3-amine is sourced from PubChem (CID 64917590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).