N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine

C9H19N — CID 129157038

IUPACN,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine
SMILESC/C=C\N(C)C(C)C(C)C
InChIInChI=1S/C9H19N/c1-6-7-10(5)9(4)8(2)3/h6-9H,1-5H3/b7-6-
InChIKeyLLTILHOSSQUCPN-SREVYHEPSA-N
MW141.26 g/mol
LogP2.50
Rot. Bonds3

About N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine

N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine (PubChem CID 129157038) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine
PubChem CID129157038
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine
SMILESC/C=C\N(C)C(C)C(C)C
InChIInChI=1S/C9H19N/c1-6-7-10(5)9(4)8(2)3/h6-9H,1-5H3/b7-6-
InChIKeyLLTILHOSSQUCPN-SREVYHEPSA-N
XLogP2.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-N,N-di(propan-2-yl)prop-1-en-1-amine
CID 45087879
(E)-3-methyl-N,N-di(propan-2-yl)but-1-en-1-amine
CID 134853882
2-methyl-N-(2-methylpropyl)-N-[(E)-prop-1-enyl]propan-1-amine
CID 13584990
N-ethyl-N-propan-2-ylprop-1-en-1-amine
CID 54050520
N,N-Bis(2-methylpropyl)prop-1-en-1-amine
CID 54063094
N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine
CID 54249358
N,2-dimethyl-N-prop-1-enylpropan-2-amine
CID 59251032
(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine
CID 59586849
(Z)-N,3-dimethyl-N-propan-2-ylbut-1-en-1-amine
CID 59887900
3-methyl-1-propan-2-yl-3,4-dihydro-2H-pyridine
CID 66821851
N,N-di(propan-2-yl)prop-1-en-1-amine
CID 75089139
N-propan-2-yl-N-prop-1-enylprop-1-en-1-amine
CID 85974945

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine?
The IUPAC name of N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine (CID 129157038) is N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine.
What is the SMILES notation for N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine?
The canonical SMILES for N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine is C/C=C\N(C)C(C)C(C)C.
What is the InChIKey of N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine?
The InChIKey is LLTILHOSSQUCPN-SREVYHEPSA-N. The full InChI is InChI=1S/C9H19N/c1-6-7-10(5)9(4)8(2)3/h6-9H,1-5H3/b7-6-.
What are the key properties of N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine?
N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine has a molecular weight of 141.26 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-[(Z)-prop-1-enyl]butan-2-amine is sourced from PubChem (CID 129157038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).