N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine

C14H28N2O — CID 153390617

IUPACN-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine
SMILESC=C(NC[C@@H]1CN(CCCC)CCO1)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-6-7-16-8-9-17-14(11-16)10-15-13(4)12(2)3/h12,14-15H,4-11H2,1-3H3/t14-/m1/s1
InChIKeyQJWADLIPZIMQRF-CQSZACIVSA-N
MW240.39 g/mol
LogP2.25
Rot. Bonds7

About N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine

N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine (PubChem CID 153390617) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine.

Molecular Properties

Compound NameN-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine
PubChem CID153390617
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine
SMILESC=C(NC[C@@H]1CN(CCCC)CCO1)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-6-7-16-8-9-17-14(11-16)10-15-13(4)12(2)3/h12,14-15H,4-11H2,1-3H3/t14-/m1/s1
InChIKeyQJWADLIPZIMQRF-CQSZACIVSA-N
XLogP2.25
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-5-morpholin-4-ylpent-1-en-2-amine
CID 58989736
(E)-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3,5-dimethylhex-3-en-1-amine
CID 70974473
(Z)-N-but-1-en-2-yl-3-methyl-2-morpholin-4-ylbut-1-en-1-amine
CID 126584067
3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine
CID 135165135
N-[2-[2-(ethylamino)ethoxy]ethyl]-N,3-dimethylbut-1-en-2-amine
CID 142615767
4-[(2-Methylidenepyrrolidin-3-yl)methyl]morpholine
CID 143282885
3-morpholin-4-yl-N-prop-1-en-2-ylpropan-1-amine
CID 144154665
N'-(3,3-dimethylbut-1-en-2-yl)ethane-1,2-diamine;2-methylpropane;4-prop-1-en-2-ylmorpholine
CID 144855148
ethane;N-[(4-ethylmorpholin-2-yl)methyl]-N,3-dimethylbut-1-en-2-amine
CID 153390428
N-[[4-[2-[2-(methylamino)ethoxy]ethyl]morpholin-2-yl]methyl]prop-1-en-2-amine
CID 153390440
N-[2-[(2R)-4-(2-methylpropyl)morpholin-2-yl]ethyl]prop-1-en-2-amine
CID 155448674
N-[[(2R)-4-ethylmorpholin-2-yl]methyl]-N,3-dimethylbut-1-en-2-amine
CID 155455436

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine?
The IUPAC name of N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine (CID 153390617) is N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine.
What is the SMILES notation for N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine?
The canonical SMILES for N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine is C=C(NC[C@@H]1CN(CCCC)CCO1)C(C)C.
What is the InChIKey of N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine?
The InChIKey is QJWADLIPZIMQRF-CQSZACIVSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-6-7-16-8-9-17-14(11-16)10-15-13(4)12(2)3/h12,14-15H,4-11H2,1-3H3/t14-/m1/s1.
What are the key properties of N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine?
N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine has a molecular weight of 240.39 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-4-butylmorpholin-2-yl]methyl]-3-methylbut-1-en-2-amine is sourced from PubChem (CID 153390617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).