N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine

C11H21N — CID 89376836

IUPACN-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine
SMILESC=CN(/C=C\C)C(C)(CC)CC
InChIInChI=1S/C11H21N/c1-6-10-12(9-4)11(5,7-2)8-3/h6,9-10H,4,7-8H2,1-3,5H3/b10-6-
InChIKeyYZFHUOIFQHZNLR-POHAHGRESA-N
MW167.30 g/mol
LogP3.54
Rot. Bonds5

About N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine

N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine (PubChem CID 89376836) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine.

Molecular Properties

Compound NameN-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine
PubChem CID89376836
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine
SMILESC=CN(/C=C\C)C(C)(CC)CC
InChIInChI=1S/C11H21N/c1-6-10-12(9-4)11(5,7-2)8-3/h6,9-10H,4,7-8H2,1-3,5H3/b10-6-
InChIKeyYZFHUOIFQHZNLR-POHAHGRESA-N
XLogP3.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine?
The IUPAC name of N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine (CID 89376836) is N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine.
What is the SMILES notation for N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine?
The canonical SMILES for N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine is C=CN(/C=C\C)C(C)(CC)CC.
What is the InChIKey of N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine?
The InChIKey is YZFHUOIFQHZNLR-POHAHGRESA-N. The full InChI is InChI=1S/C11H21N/c1-6-10-12(9-4)11(5,7-2)8-3/h6,9-10H,4,7-8H2,1-3,5H3/b10-6-.
What are the key properties of N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine?
N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine has a molecular weight of 167.30 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-3-methyl-N-[(Z)-prop-1-enyl]pentan-3-amine is sourced from PubChem (CID 89376836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).