(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine

C14H30N2O — CID 97232472

IUPAC(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine
SMILESCC[C@H](NC[C@@H](C)CN1CCOCC1)C(C)C
InChIInChI=1S/C14H30N2O/c1-5-14(12(2)3)15-10-13(4)11-16-6-8-17-9-7-16/h12-15H,5-11H2,1-4H3/t13-,14+/m1/s1
InChIKeySOWNJVOVVPZNRA-KGLIPLIRSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds7

About (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine

(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine (PubChem CID 97232472) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine.

Molecular Properties

Compound Name(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine
PubChem CID97232472
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine
SMILESCC[C@H](NC[C@@H](C)CN1CCOCC1)C(C)C
InChIInChI=1S/C14H30N2O/c1-5-14(12(2)3)15-10-13(4)11-16-6-8-17-9-7-16/h12-15H,5-11H2,1-4H3/t13-,14+/m1/s1
InChIKeySOWNJVOVVPZNRA-KGLIPLIRSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine with MolForge

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Related Compounds

N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
CID 115722394
2-methyl-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675679
ethane;4-(2-methylbutyl)morpholine
CID 142525427
N-(1-cyclopropylethyl)-2-methyl-3-morpholin-4-ylpropan-1-amine
CID 115677223
4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine
CID 43769799
(2R)-1-(1-morpholin-4-ylpropan-2-ylamino)propan-2-ol
CID 106931969
3-methoxy-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)propan-1-amine
CID 116500887
N-(2-methyl-3-morpholin-4-ylpropyl)cyclopentanamine
CID 115641946
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
trimethyl-(2-methyl-3-morpholin-4-ylpropyl)silane
CID 10488877
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449
2-methyl-1-(2-methyl-3-morpholin-4-ylpropyl)-3-(2-methylpropyl)guanidine
CID 111835613

Frequently Asked Questions

What is the IUPAC name of (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine?
The IUPAC name of (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine (CID 97232472) is (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine.
What is the SMILES notation for (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine?
The canonical SMILES for (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine is CC[C@H](NC[C@@H](C)CN1CCOCC1)C(C)C.
What is the InChIKey of (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine?
The InChIKey is SOWNJVOVVPZNRA-KGLIPLIRSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-14(12(2)3)15-10-13(4)11-16-6-8-17-9-7-16/h12-15H,5-11H2,1-4H3/t13-,14+/m1/s1.
What are the key properties of (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine?
(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine is sourced from PubChem (CID 97232472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).