N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine

C12H26N2O — CID 115722394

IUPACN-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
SMILESCCC(C)NCC(C)CN1CCOCC1
InChIInChI=1S/C12H26N2O/c1-4-12(3)13-9-11(2)10-14-5-7-15-8-6-14/h11-13H,4-10H2,1-3H3
InChIKeyMHGHSSONYLKQQO-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds6

About N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine

N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine (PubChem CID 115722394) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
PubChem CID115722394
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
SMILESCCC(C)NCC(C)CN1CCOCC1
InChIInChI=1S/C12H26N2O/c1-4-12(3)13-9-11(2)10-14-5-7-15-8-6-14/h11-13H,4-10H2,1-3H3
InChIKeyMHGHSSONYLKQQO-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675679
(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine
CID 97232472
ethane;4-(2-methylbutyl)morpholine
CID 142525427
(2R)-1-(1-morpholin-4-ylpropan-2-ylamino)propan-2-ol
CID 106931969
N-(1-cyclopropylethyl)-2-methyl-3-morpholin-4-ylpropan-1-amine
CID 115677223
3-methoxy-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)propan-1-amine
CID 116500887
N-(2,2-dimethoxyethyl)-1-morpholin-4-ylpropan-2-amine
CID 63684989
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
CID 80694695
2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 66047361
1-(1,4-oxazepan-4-yl)-N-propylpropan-2-amine
CID 62988157
N-(2-methyl-3-morpholin-4-ylpropyl)cyclopentanamine
CID 115641946

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine (CID 115722394) is N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine is CCC(C)NCC(C)CN1CCOCC1.
What is the InChIKey of N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine?
The InChIKey is MHGHSSONYLKQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-12(3)13-9-11(2)10-14-5-7-15-8-6-14/h11-13H,4-10H2,1-3H3.
What are the key properties of N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine?
N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 115722394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).