N-methyl-N-pent-1-en-3-ylpentan-1-amine

C11H23N — CID 123466657

IUPACN-methyl-N-pent-1-en-3-ylpentan-1-amine
SMILESC=CC(CC)N(C)CCCCC
InChIInChI=1S/C11H23N/c1-5-8-9-10-12(4)11(6-2)7-3/h6,11H,2,5,7-10H2,1,3-4H3
InChIKeyGNOMFJNDJQQZCJ-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.07
Rot. Bonds7

About N-methyl-N-pent-1-en-3-ylpentan-1-amine

N-methyl-N-pent-1-en-3-ylpentan-1-amine (PubChem CID 123466657) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-methyl-N-pent-1-en-3-ylpentan-1-amine.

Molecular Properties

Compound NameN-methyl-N-pent-1-en-3-ylpentan-1-amine
PubChem CID123466657
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-methyl-N-pent-1-en-3-ylpentan-1-amine
SMILESC=CC(CC)N(C)CCCCC
InChIInChI=1S/C11H23N/c1-5-8-9-10-12(4)11(6-2)7-3/h6,11H,2,5,7-10H2,1,3-4H3
InChIKeyGNOMFJNDJQQZCJ-UHFFFAOYSA-N
XLogP3.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyloct-1-en-3-amine
CID 123653053
1-[methyl(pentyl)amino]propan-1-ol
CID 87216398
N,N-dimethylhenicos-1-en-3-amine
CID 174322133
N,N-dimethylnonadec-1-en-3-amine
CID 174330581
N'-hept-1-en-3-yl-N,N,N'-trimethylmethanediamine
CID 146420485
2-N-methyl-2-N-pentyl-1-N-prop-2-enylpropane-1,2-diamine
CID 62568971
N-methyl-N-propan-2-yltridecan-1-amine
CID 88970420
formic acid;N-methyl-N-propan-2-ylhexan-1-amine
CID 169177535
1-[decyl(methyl)amino]propan-1-ol;hydrochloride
CID 175358956
N,N-bis(hept-1-en-3-yl)hept-1-en-3-amine
CID 87378366
ethane;N-methyl-N-propan-2-yldodecan-1-amine
CID 142585410
N-dodecyl-N-methyltridecan-2-amine
CID 87784054

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-pent-1-en-3-ylpentan-1-amine?
The IUPAC name of N-methyl-N-pent-1-en-3-ylpentan-1-amine (CID 123466657) is N-methyl-N-pent-1-en-3-ylpentan-1-amine.
What is the SMILES notation for N-methyl-N-pent-1-en-3-ylpentan-1-amine?
The canonical SMILES for N-methyl-N-pent-1-en-3-ylpentan-1-amine is C=CC(CC)N(C)CCCCC.
What is the InChIKey of N-methyl-N-pent-1-en-3-ylpentan-1-amine?
The InChIKey is GNOMFJNDJQQZCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-8-9-10-12(4)11(6-2)7-3/h6,11H,2,5,7-10H2,1,3-4H3.
What are the key properties of N-methyl-N-pent-1-en-3-ylpentan-1-amine?
N-methyl-N-pent-1-en-3-ylpentan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 3.07, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pent-1-en-3-ylpentan-1-amine is sourced from PubChem (CID 123466657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).